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1H-indole-2-carboxylic acid, 3-[(E)-[3-(1-carboxy-2-methylpropyl)-4-oxo-2-thioxo-5-thiazolidinylidene]methyl]-5-fluoro-, methyl ester

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1H-indole-2-carboxylic acid, 3-[(E)-[3-(1-carboxy-2-methylpropyl)-4-oxo-2-thioxo-5-thiazolidinylidene]methyl]-5-fluoro-, methyl ester
SpectraBase Compound ID G0zsZpTSG1n
InChI InChI=1S/C19H17FN2O5S2/c1-8(2)15(17(24)25)22-16(23)13(29-19(22)28)7-11-10-6-9(20)4-5-12(10)21-14(11)18(26)27-3/h4-8,15,21H,1-3H3,(H,24,25)/b13-7+
InChIKey RKKCCQOYZLVTNZ-NTUHNPAUSA-N
Mol Weight 436.47 g/mol
Molecular Formula C19H17FN2O5S2
Exact Mass 436.056292 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CFWLZt5kS9j
Name 1H-indole-2-carboxylic acid, 3-[(E)-[3-(1-carboxy-2-methylpropyl)-4-oxo-2-thioxo-5-thiazolidinylidene]methyl]-5-fluoro-, methyl ester
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C19H17FN2O5S2/c1-8(2)15(17(24)25)22-16(23)13(29-19(22)28)7-11-10-6-9(20)4-5-12(10)21-14(11)18(26)27-3/h4-8,15,21H,1-3H3,(H,24,25)/b13-7+
InChIKey RKKCCQOYZLVTNZ-NTUHNPAUSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_8993
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: F33948; Labnumber: EXGOR1-18752